A-500359 A
AlkaPlorer ID: AK025857
Synonym: None
IUPAC Name: (2S,3S,4S)-2-[(1R)-2-amino-1-[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-methoxyoxolan-2-yl]-2-oxoethoxy]-3,4-dihydroxy-N-[(3S,7R)-7-methyl-2-oxoazepan-3-yl]-3,4-dihydro-2H-pyran-6-carboxamide
Structure
SMILES: CO[C@H]1[C@@H](O)[C@H](N2C=CC(O)=NC2=O)O[C@@H]1[C@@H](O[C@H]1OC(C(O)=N[C@H]2CCC[C@@H](C)N=C2O)=C[C@H](O)[C@@H]1O)C(=N)O
InChI: InChI=1S/C24H33N5O12/c1-9-4-3-5-10(20(35)26-9)27-21(36)12-8-11(30)14(32)23(39-12)41-18(19(25)34)17-16(38-2)15(33)22(40-17)29-7-6-13(31)28-24(29)37/h6-11,14-18,22-23,30,32-33H,3-5H2,1-2H3,(H2,25,34)(H,26,35)(H,27,36)(H,28,31,37)/t9-,10+,11+,14+,15-,16+,17+,18-,22-,23-/m1/s1
InChIKey: RVEJXOKUHHMFKS-BPJITGRLSA-N
Reference
Identification of the biosynthetic gene cluster of A-500359s in Streptomyces griseus SANK60196
PubChem CID: 5495616
LOTUS: LTS0173670
{NPAtlas: NPA024713
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces griseus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 583.5510000000004
TPSA？: 261.99
MolLogP？: -1.0413299999999943
Number of H-Donors: 8
Number of H-Acceptors: 14
RingCount: 4